CID 168355167

9(r)-hexahydrocannabiphorol

Structural Information

Molecular Formula

C₂₃H₃₆O₂

SMILES

CCCCCCCC1=CC(=C2[C@@H]3C[C@@H](CC[C@H]3C(OC2=C1)(C)C)C)O

InChI

InChI=1S/C23H36O2/c1-5-6-7-8-9-10-17-14-20(24)22-18-13-16(2)11-12-19(18)23(3,4)25-21(22)15-17/h14-16,18-19,24H,5-13H2,1-4H3/t16-,18-,19-/m1/s1

InChIKey

USZILQYXSONCHH-BHIYHBOVSA-N

Compound name

(6aR,9R,10aR)-3-heptyl-6,6,9-trimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 344.27155 Da
Monoisotopic Mass: 8.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	345.278826	188.8
[M+Na]+	367.260768	193.9
[M-H]-	343.264274	192.0
[M+NH4]+	362.305373	204.9
[M+K]+	383.234708	189.5
[M+H-H2O]+	327.268810	181.5
[M+HCOO]-	389.269751	200.0
[M+CH3COO]-	403.285401	216.9
[M+Na-2H]-	365.246216	189.5
[M]+	344.27100142	188.9
[M]-	344.27209858	188.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.